Marvin  07081315162D          

 22 24  0  0  0  0            999 V2000
   20.2837  -13.8377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8540  -13.2396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6171  -12.4442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8161  -12.2535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4820  -13.6433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2452  -12.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8004  -14.1139    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.1422  -13.6111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4196  -12.8321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8841  -12.2045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0712  -12.3547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7967  -13.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3339  -13.7622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5829  -11.4629    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1511  -10.8656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1836  -11.8453    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.9855  -12.0363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6554  -13.4323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5160  -14.6287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3171  -14.8229    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   21.5494  -15.6138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8859  -14.2263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  5  6  2  0  0  0  0
 10 11  2  0  0  0  0
  1  2  2  0  0  0  0
 11 12  1  0  0  0  0
  5  1  1  0  0  0  0
 12 13  2  0  0  0  0
 13  8  1  0  0  0  0
  2  3  1  0  0  0  0
  4 14  1  0  0  0  0
  6  9  1  0  0  0  0
 14 15  1  0  0  0  0
  8  7  1  0  0  0  0
  3 16  1  0  0  0  0
  7  5  1  0  0  0  0
 16 17  1  0  0  0  0
  2 18  1  0  0  0  0
  3  4  2  0  0  0  0
  1 19  1  0  0  0  0
  8  9  2  0  0  0  0
 19 20  1  0  0  0  0
  4  6  1  0  0  0  0
 20 21  1  1  0  0  0
  9 10  1  0  0  0  0
 20 22  1  0  0  0  0
M  END
> <ID>
CHEBI:66525

> <NAME>
streptoverticillin

> <DEFINITION>
A carbazole alkaloid that is 9H-carbazole substituted by a methyl group at position 2, methoxy groups at positions 3 and 4 and a (2S)-2-hydroxypropyl group at position 1. Isolated from mycelial solid culture of Streptoverticillium morookaense, it exhibits antifungal activity.

> <STAR>
3

> <IUPAC_NAME>
(2R)-1-(3,4-dimethoxy-2-methyl-9H-carbazol-1-yl)propan-2-ol

> <FORMULA>
C18H21NO3

> <MASS>
299.36420

> <MONOISOTOPIC_MASS>
299.15214

> <CHARGE>
0

> <SMILES>
COc1c(C)c(C[C@@H](C)O)c2[nH]c3ccccc3c2c1OC

> <INCHI>
InChI=1S/C18H21NO3/c1-10(20)9-13-11(2)17(21-3)18(22-4)15-12-7-5-6-8-14(12)19-16(13)15/h5-8,10,19-20H,9H2,1-4H3/t10-/m1/s1

> <INCHIKEY>
BSCARUQHRDHPML-SNVBAGLBSA-N

> <REAXYS_REGISTRY_NUMBER>
21969436

> <PUBMED_CITATION>
17446689

$$$$