ID: 62224
SMILES:c1(CCCC(=CC(C=CCC)C(C)C)C)cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -13.74
InChIKey:KLLXUOYYXKMTHX-UHFFFAOYSA-N
ID: 62225
SMILES:C12(C)C3(C)C4CC1(c1c(cc(CCCCC)cc1O)O4)CCC(C2)C3(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -13.896
InChIKey:UQQCCQZCLKNIJS-UHFFFAOYSA-N
ID: 62226
SMILES:CC(C)Cc1cc2c(c(O)c1)C1C(C(O)(C)C)(C(O)CC(C)C1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -13.458
InChIKey:UJSFFGUDXQNBKP-UHFFFAOYSA-N
ID: 62227
SMILES:COc1c(CCCCC)cc(O)c2c1OC1(C)C3C(C2O1)CC(C)(C)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.584
InChIKey:VHHUILMVHXMSPM-UHFFFAOYSA-N
ID: 62228
SMILES:C1C2c3c(cc(CCCCC)cc3OC(=O)CCCCCCCCC)C(=O)OC2C(O)C1=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.717
InChIKey:AIYDMUUDEFDQDG-UHFFFAOYSA-N
ID: 62229
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCC)c32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.502
InChIKey:GGHBZYUXMUKFME-UHFFFAOYSA-N
ID: 62230
SMILES:Oc1cc(CC)cc(O)c1C1CC(C)=CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.979
InChIKey:ULASTLGOVDSGEJ-UHFFFAOYSA-N
ID: 62231
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C(=O)OC)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 62232
SMILES:C1C(O)C(C)(C)Oc2c(c(O)cc(CCCCC)c2O)C2C=C(C(OC)=O)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -12.626
InChIKey:PTIMCMAIRQELMF-UHFFFAOYSA-N
ID: 62233
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2c1ccc(C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 62234
SMILES:c1(O)c2c(cc(O)c1C(O)CCCC)OC(C)(C)c1c2cc(C)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.885
InChIKey:OQXYFIQBTDYDLQ-UHFFFAOYSA-N
ID: 62235
SMILES:c1(C)ccc2c(c1)-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 62236
SMILES:C(C)(C)=CCc1ccc2c(c1)OC(C)(C)C1CCC(C)C(Cl)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.915
CB1 binding score: -15.968
InChIKey:VUUCQYUCTMCZNO-UHFFFAOYSA-N
ID: 62237
SMILES:c1(O)c(-c2c(OC)ccc(CCCCC)c2)c(O)c2c(c1)OC(C)(C)C1CCC(C)C(=O)C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -16.217
InChIKey:WTDPCZYKWLMCPY-UHFFFAOYSA-N
ID: 62238
SMILES:CC(=C(C)C=CC(c1c2c(c3c(c(CCCC)cc1O)OC(C)(C)C1C3C=C(C)CC1)C=C2C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.696
CB1 binding score: -16.113
InChIKey:JDIKMSHNHRAAPG-UHFFFAOYSA-N
ID: 62239
SMILES:c12c(cc(CC(O)CC)c(O)c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.823
InChIKey:ROUAJTNPEUKOHS-UHFFFAOYSA-N
ID: 62240
SMILES:COc1c(O)cc2c(c1)-c1c(c(C)cc(c1OC)O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.51
CB1 binding score: -18.439
InChIKey:QEZYSHFYYICLAK-UHFFFAOYSA-N
ID: 62241
SMILES:c1c(OC(CC(C)CC)=O)c(O)c2c(c1)OC(C)(C)C1CC=C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.706
InChIKey:ISYVYWYNWLPWSU-UHFFFAOYSA-N
ID: 62242
SMILES:C1CC(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCc2ccccc2)cc3=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.523
CB1 binding score: -12.543
InChIKey:KUIUUMPBJRQFMP-UHFFFAOYSA-N
ID: 62243
SMILES:C1C(c2c(O)cc(CCCCC)cc2O)OC(=O)C1=CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.123
InChIKey:STZVJDXWRCEFFY-UHFFFAOYSA-N
ID: 62244
SMILES:c1(C(=O)O)c(CCCCC)cc(O)c2c1OC1(C)C(C2)OC(=O)C(=CC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -13.594
InChIKey:CDQHHOMYZBRYRQ-UHFFFAOYSA-N