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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H30O2
Molecular Weight 302.451
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEOABIETIC ACID

SMILES

[H][C@]12CCC(C=C1CC[C@@]3([H])[C@@](C)(CCC[C@]23C)C(O)=O)=C(C)C

InChI

InChIKey=KGMSWPSAVZAMKR-ONCXSQPRSA-N
InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h12,16-17H,5-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H30O2
Molecular Weight 302.451
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Cancer chemopreventive activity of "rosin" constituents of Pinus spez. and their derivatives in two-stage mouse skin carcinogenesis test.
2008 Nov
13-Ethoxy-carbonyl-16-(1-methyl-ethyl)-17,19-dinoratis-15-ene-4,14-dicarboxylic acid monohydrate: a new derivative of maleopimaric acid.
2009 Jul 22
Maleopimaric acid acetic acid solvate.
2009 Jun 27
Chemical composition of natural colophony from Pinus brutia and comparison with synthetic colophony.
2010 Nov
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:22:19 GMT 2023
Edited
by admin
on Sat Dec 16 08:22:19 GMT 2023
Record UNII
8I5YI4CXJ7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEOABIETIC ACID
Common Name English
PODOCARP-8(14)-EN-15-OIC ACID, 13-ISOPROPYLIDENE-
Common Name English
1-PHENANTHRENECARBOXYLIC ACID, 1,2,3,4,4A,4B,5,6,7,9,10,10A-DODECAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYLIDENE)-, (1R,4AR,4BS,10AR)-
Common Name English
CTCM-189
Code English
NSC-5007
Code English
Code System Code Type Description
PUBCHEM
221118
Created by admin on Sat Dec 16 08:22:19 GMT 2023 , Edited by admin on Sat Dec 16 08:22:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID8022038
Created by admin on Sat Dec 16 08:22:19 GMT 2023 , Edited by admin on Sat Dec 16 08:22:19 GMT 2023
PRIMARY
CAS
471-77-2
Created by admin on Sat Dec 16 08:22:19 GMT 2023 , Edited by admin on Sat Dec 16 08:22:19 GMT 2023
PRIMARY
NSC
5007
Created by admin on Sat Dec 16 08:22:19 GMT 2023 , Edited by admin on Sat Dec 16 08:22:19 GMT 2023
PRIMARY
FDA UNII
8I5YI4CXJ7
Created by admin on Sat Dec 16 08:22:19 GMT 2023 , Edited by admin on Sat Dec 16 08:22:19 GMT 2023
PRIMARY