| Compound-ID | 8417 |
| Common Name | GT1b |
| Synonyms |
Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer
Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)LacCer |
| InChI |
InChI=1S/C78H131N5O47/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-37(96)36(79-31-91)30-117-70-58(108)57(107)61(46(28-89)120-70)122-72-60(110)68(130-78(75(115)116)22-40(99)50(82-34(4)94)66(128-78)56(106)45(27-88)125-76(73(111)112)20-38(97)48(80-32(2)92)64(126-76)52(102)41(100)23-84)62(47(29-90)121-72)123-69-51(83-35(5)95)63(54(104)43(25-86)118-69)124-71-59(109)67(55(105)44(26-87)119-71)129-77(74(113)114)21-39(98)49(81-33(3)93)65(127-77)53(103)42(101)24-85/h18-19,31,36-72,84-90,96-110H,6-17,20-30H2,1-5H3,(H,79,91)(H,80,92)(H,81,93)(H,82,94)(H,83,95)(H,111,112)(H,113,114)(H,115,116)/b19-18+/t36-,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+,62-,63+,64+,65+,66+,67-,68+,69-,70+,71-,72-,76+,77-,78-/m0/s1
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| SMILES |
[*]C(=O)NC(COC7OC(CO)C(OC6OC(CO)C(OC3OC(CO)C(O)C(OC2OC(CO)C(O)C(OC1(CC(O)C(NC(C)=O)C([H])(O1)C(O)C(O)CO)C(O)=O)C2(O))C3(NC(C)=O))C(OC4(CC(O)C(NC(C)=O)C([H])(O4)C(O)C(CO)OC5(CC(O)C(NC(C)=O)C([H])(O5)C(O)C(O)CO)C(O)=O)C(O)=O)C6(O))C(O)C7(O))C(O)C=CCCCCCCCCCCCCC
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| External Links | |
| KEGG-COMPOUND-ID |
C06140
|
| PUBCHEM-ID | 8396 |
| ChEBI-ID |
28058
|
| METANETX-ID | MNXM732821 |
| BioModels |
28058 |
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View all entries for compound: GT1b |