ID: 54223
SMILES:C1=C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 54224
SMILES:c1(COC2OC(CO)C(O)C(O)C2O)cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.5
CB1 binding score: -17.291
InChIKey:DKJTUVOWMIMDSP-UHFFFAOYSA-N
ID: 54225
SMILES:C(C)(C)=CCCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 54226
SMILES:c1c(CCCc2cc3c(cc2C)OC(C)(C)C2C3C(C)(C)C2O)cccc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -17.123
InChIKey:SNWUZNIAYNOGBU-UHFFFAOYSA-N
ID: 54227
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 54228
SMILES:CC1=CC2C(C(C)(C)Oc3c(c(O)cc4c3CC3C(C(C)(C)O4)C3)CC1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.448
InChIKey:NWDVHPFWAOKZQD-UHFFFAOYSA-N
ID: 54229
SMILES:c1(CCc2ccc(O)c(OC)c2)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -16.01
InChIKey:YWIDWLJMOMVUBM-UHFFFAOYSA-N
ID: 54230
SMILES:C(=C(C)C)CCC(=CCCC1(C)Oc2c(c(O)cc(CCCCCO)c2)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.116
InChIKey:VKAFPODYVRCKDO-UHFFFAOYSA-N
ID: 54231
SMILES:CC(c1ccc2c(c1)OC(C)(C)C1CCC(C)C(O)C21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.932
InChIKey:NOXJDOMZSVGIJS-UHFFFAOYSA-N
ID: 54232
SMILES:C=C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 54233
SMILES:CC1=C2CC(=O)CC3Oc4c(c(O)cc(CCC)c4)C3C=C2C(O)(CC=C(C)C)OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.52
CB1 binding score: -18.285
InChIKey:JLDOLEPZPSSPDU-UHFFFAOYSA-N
ID: 54234
SMILES:c12c(cc(CCCCC)cc1O)C1C=C(C)C(OC(=O)C)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -11.348
InChIKey:BRBDKPUNRMUMOS-UHFFFAOYSA-N
ID: 54235
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2=C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.728
InChIKey:RECLSNODOVFMMU-UHFFFAOYSA-N
ID: 54236
SMILES:C1(C(C)=C)CC(O)C23Cc4c(cc(C)cc4O)OC2(C)CC(Cl)C13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.87
CB1 binding score: -14.578
InChIKey:ZWYFHYWCUUYPRZ-UHFFFAOYSA-N
ID: 54237
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)C1CCC1=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.367
InChIKey:BOPITUZWWSIPKS-UHFFFAOYSA-N
ID: 54238
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 54239
SMILES:O(c1c(O)cc(CCC)cc1O)CC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.527
InChIKey:NLNRMEBLDWYUJH-UHFFFAOYSA-N
ID: 54240
SMILES:c1(OC)cc(CCCCC)c(C2C=C(C)C3CC(C(=C)C)CCC(C)=C3C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -16.129
InChIKey:MWVRZXIPJYWNEX-UHFFFAOYSA-N
ID: 54241
SMILES:C1(C)=CC2C(CC1)C(CO)(C)Oc1c2c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -14.853
InChIKey:SYXRCANUFYHTAY-UHFFFAOYSA-N
ID: 54242
SMILES:C12=C3C(C4(C(=O)C1C(=O)OC)c1c(cc5c(c1)OC5(C)C)OC2C(O)C(C)(C)O4)C(C)(C)OC(C)(C)C3=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.582
CB1 binding score: -16.315
InChIKey:GBIQVWWSFSIEFK-UHFFFAOYSA-N
ID: 54243
SMILES:C(CCCCCC)C(=O)c1cc(O)c(C2C(C(C)(C)O)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.249
InChIKey:LDXMNIXPSPYANA-UHFFFAOYSA-N