6α-hydroxy-germacra-1(10),4,11(13)-trien-12-oate
Chemical Formula:
C15H21O3
Molecular Weight:
249.329 Daltons
Monoisotopic Mass:
250.1568945725 Daltons
SMILES:
CC1(=CCCC(C)=CC(O)[CH](C(C(=O)[O-])=C)CC1)
InChI:
1S/C15H22O3/c1-10-5-4-6-11(2)9-14(16)13(8-7-10)12(3)15(17)18/h5,9,13-14,16H,3-4,6-8H2,1-2H3,(H,17,18)/p-1/b10-5+,11-9+/t13-,14+/m0/s1
InChIKey:
Synonyms
- 6α-hydroxy-germacra-1(10),4,11(13)-trien-12-oic acid
- 6α-germacrene A acid
Databases
MetaCyc:
CPD-16700
PubChem (CID):
90659153
MetaNetX:
MNXM147869
ChEBI:
141318