Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

Anabsin

PropertiesImageOccurences in reactions
MNX_IDMNXM119177Image of MNXM119177
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC30H40O7
charge0
mass512.2774
referencehmdb:HMDB0036414
InChIKeyOVZIMEDUADJHPN-ORIANPTGSA-N
InChIInChI=1S/C30H40O7/c1-11-14-7-9-27(4,34)20-16(21(14)35-25(11)32)13(3)19-17(20)18-22-28(5)10-8-15-12(2)26(33)36-24(15)30(19,22)29(6,37-28)23(18)31/h11-12,14-15,17-24,31,34H,7-10H2,1-6H3/t11-,12-,14-,15-,17-,18-,19-,20-,21-,22-,23+,24-,27-,28+,29+,30?/m0/s1
SMILESCC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@](C)(O)[C@@H]2[C@H]2[C@@H]3[C@@H](O)[C@@]4(C)O[C@]5(C)CC[C@H]6[C@H](C)C(=O)O[C@@H]6C4([C@@H]12)[C@@H]35
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0036414 Anabsin
(2R,5S,8S,9S,12S,13R,14R,15S,16R,17S,19R,22S,23S,26S,27R)-12,16-dihydroxy-3,8,12,17,19,23-hexamethyl-6,18,25-trioxaoctacyclo[13.11.1.0¹,¹⁷.0²,¹⁴.0⁴,¹³.0⁵,⁹.0¹⁹,²⁷.0²²,²⁶]heptacos-3-ene-7,24-dione
hmdb:HMDB36414 secondary/obsolete/fantasy identifier