XAT
Molecular Formula:
C40H56O4
InChI: InChI=1/C40H56O4/c1-29(17-13-19-31(3)21-23-39-35(5,6)25-33(41)27-37(39,9)43-39)15-11-12-16-30(2)18-14-20-32(4)22-24-40-36(7,8)26-34(42)28-38(40,10)44-40/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21u,24-22u,29-15+,30-16+,31-19+,32-20+/t33-,34-,37+,38+,39u,40u/m0/s1
InChIKey: InChIKey=SZCBXWMUOPQSOX-YLRKNNKUBB
SMILES: CC(=CC=CC=C(C)C=CC=C(C)C=CC12C(CC(CC1(O2)C)O)(C)C)C=CC=C(C)C=CC34C(CC(CC3(O4)C)O)(C)C
Names:
XAT
(4S,6R)-1-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-3,7,12,16-tetramethyl-octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-4-ol
Registries:
PubChem CID 6852159
PubChem ID 11532219
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