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(8aS,12aS)-12a-methoxycarbonyl-7,8,9,12-tetrahydrobenzo[c]phenanthrene-8a-carboxylic acid

(8aS,12aS)-12a-methoxycarbonyl-7,8,9,12-tetrahydrobenzo[c]phenanthrene-8a-carboxylic acid

Systemtic Name:(8aS,12aS)-12a-methoxycarbonyl-7,8,9,12-tetrahydrobenzo[c]phenanthrene-8a-carboxylic acid
Openeye Name:(8aS,12aS)-12a-methoxycarbonyl-7,8,9,12-tetrahydrobenzo[c]phenanthrene-8a-carboxylic acid
CAS Name:(8aS,12aS)-12a-methoxycarbonyl-7,8,9,12-tetrahydrobenzo[c]phenanthrene-8a-carboxylic acid
IUPAC Name:(8aS,12aS)-12a-methoxycarbonyl-7,8,9,12-tetrahydrobenzo[c]phenanthrene-8a-carboxylic acid
Traditional Name:(8aS,12aS)-12a-carbomethoxy-7,8,9,12-tetrahydrobenzo[c]phenanthrene-8a-carboxylic acid
Formula: C21H20O4
MolecularWeight: 336.3811
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CC=CCC1(CCC3=C2C4=CC=CC=C4C=C3)C(=O)O


Isomeric SMILES

COC(=O)[C@]12CC=CC[C@]1(CCC3=C2C4=CC=CC=C4C=C3)C(=O)O


InChI

InChI=1S/C21H20O4/c1-25-19(24)21-12-5-4-11-20(21,18(22)23)13-10-15-9-8-14-6-2-3-7-16(14)17(15)21/h2-9H,10-13H2,1H3,(H,22,23)/t20-,21+/m0/s1


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