acetyl-podocarpic dimer (Q27074155)

acetyl-podocarpic dimer (English)

3 October 2016

chemical formula

C₃₈H₄₆O₇

1 reference

acetyl-podocarpic dimer (English)

3 October 2016

canonical SMILES

CC(=O)OC1=CC2=C(CCC3C2(CCCC3(C)C(=O)OC(=O)C4(CCCC5(C4CCC6=C5C=C(C=C6)OC(=O)C)C)C)C)C=C1

1 reference

acetyl-podocarpic dimer (English)

3 October 2016

isomeric SMILES

CC(=O)OC1=CC2=C(CC[C@@H]3[C@@]2(CCC[C@]3(C)C(=O)OC(=O)[C@]4(CCC[C@]5([C@H]4CCC6=C5C=C(C=C6)OC(=O)C)C)C)C)C=C1

1 reference

acetyl-podocarpic dimer (English)

InChI=1S/C38H46O7/c1-23(39)43-27-13-9-25-11-15-31-35(3,29(25)21-27)17-7-19-37(31,5)33(41)45-34(42)38(6)20-8-18-36(4)30-22-28(44-24(2)40)14-10-26(30)12-16-32(36)38/h9-10,13-14,21-22,31-32H,7-8,11-12,15-20H2,1-6H3/t31-,32-,35-,36-,37+,38+/m1/s1

3 October 2016

Identifiers

InChI

1 reference

acetyl-podocarpic dimer (English)

OUJQRQRBNRGQTC-SPGSYPTKSA-N

3 October 2016

InChIKey

1 reference

acetyl-podocarpic dimer (English)

3 October 2016

1 reference

(1S,4aS,10aR)-6-Acetoxy-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydro-1-phenanthrenecarboxylic anhydride (English)

3 October 2016

1 reference

acetyl-podocarpic dimer (English)

3 October 2016

ChEBI ID

187403

mapping relation type

exact match

1 reference

stated in

ChEBI release 2022-06-13

1 reference

Guide to Pharmacology Ligand ID

ACETYL PODOCARPIC ACID ANHYDRIDE (English)

3 October 2016

1 reference

2753

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

2753

acetyl-podocarpic dimer (English)