None

AlkaPlorer ID: AK318410

Synonym: None

IUPAC Name: None

Structure

SMILES: CC(O)=N[C@H]1[C@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O[C@@H]7OC[C@](O)(CO)[C@H]7O)[C@H]6O[C@@H]6OC[C@](O)(CO)[C@H]6O)CC[C@@]5(C)[C@]4(C)[C@H](O)[C@H](O)[C@H]3C2(C)C)O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O

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InChI: InChI=1S/C70H113NO36/c1-27(76)71-37-48(104-57-44(85)39(80)31(78)21-95-57)41(82)34(22-96-56-43(84)38(79)30(77)20-94-56)101-55(37)102-36-11-12-65(6)35-10-9-28-29-17-63(2,3)13-15-68(29,16-14-66(28,7)67(35,8)52(88)46(87)51(65)64(36,4)5)62(91)107-59-50(106-61-54(90)70(93,24-75)26-98-61)49(105-60-53(89)69(92,23-74)25-97-60)47(33(19-73)100-59)103-58-45(86)42(83)40(81)32(18-72)99-58/h9,29-61,72-75,77-90,92-93H,10-26H2,1-8H3,(H,71,76)/t29-,30-,31+,32+,33+,34+,35+,36-,37+,38-,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49-,50+,51-,52+,53-,54-,55-,56-,57-,58-,59-,60-,61-,65+,66+,67-,68-,69+,70+/m0/s1

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InChIKey: IGKSOTOHWYOTSN-ODHQTZHZSA-N

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Properties Information

Molecule Weight: 1544.645000000001

TPSA: 583.4800000000002

MolLogP: -7.077400000000035

Number of H-Donors: 21

Number of H-Acceptors: 36

RingCount: 12

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information