(Q125617422)

English

3-[[(1R,2R,4bR,7R,8aR,10aS)-7-hydroxy-1,2,4b,8,8-pentamethyl-3,5,6,7,8a,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl]-4-hydroxybenzoic acid

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

426.27700969599994 dalton

1 reference

1 reference

C₂₇H₃₈O₄

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canonical SMILES

O=C(O)C1=CC=C(O)C(=C1)CC2(C)C3C(=CCC2C)C4(C)CCC(O)C(C)(C)C4CC3

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isomeric SMILES

C[C@@H]1CC=C2[C@@H](CC[C@H]3C(C)(C)[C@H](O)CC[C@@]23C)[C@]1(C)Cc1cc(C(=O)O)ccc1O

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found in taxon

Nostoc commune

1 reference

stated in

A novel extracellular diterpenoid with antibacterial activity from the cyanobacterium Nostoc commune

Identifiers

InChI

InChI=1S/C27H38O4/c1-16-6-8-19-20(9-11-22-25(2,3)23(29)12-13-26(19,22)4)27(16,5)15-18-14-17(24(30)31)7-10-21(18)28/h7-8,10,14,16,20,22-23,28-29H,6,9,11-13,15H2,1-5H3,(H,30,31)/t16-,20-,22+,23-,26+,27-/m1/s1

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InChIKey

HWGPBUBDNCZOBN-RKSFUGBBSA-N

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2 references

26 April 2024

inferred from InChIKey

matched by identifier from

InChIKey

HWGPBUBDNCZOBN-RKSFUGBBSA-N

(Q125617422)

3-[[(1R,2R,4bR,7R,8aR,10aS)-7-hydroxy-1,2,4b,8,8-pentamethyl-3,5,6,7,8a,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl]-4-hydroxybenzoic acid

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Identifiers

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