ID: 32152
SMILES:C12C(C(O)=O)=CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.61
InChIKey:VADYXRSZBJCVBB-UHFFFAOYSA-N
ID: 32153
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)CC(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.212
InChIKey:HXVCJUVAUXUDCD-UHFFFAOYSA-N
ID: 32154
SMILES:C1C(C(C)C)CCC(C)C12Oc1c(c(O)cc(CCCCC)c1)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -14.513
InChIKey:KQTIGWAPKJEHOW-UHFFFAOYSA-N
ID: 32155
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2(O)C1=C(C(=O)C(CC)C)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.338
InChIKey:XQQFWIIXFHOYCB-UHFFFAOYSA-N
ID: 32156
SMILES:c1(C(C(O)C(C(C)C)=O)C)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.981
InChIKey:SFLQMIFOSZHNAT-UHFFFAOYSA-N
ID: 32157
SMILES:O1c2c(c(O)c(C(=O)O)c(CCCCC)c2)C2CC(O)(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.123
InChIKey:VSZQEUYHLCIKBY-UHFFFAOYSA-N
ID: 32158
SMILES:O=c1ccc2c(c(CCCCC)c1)OC(C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.019
InChIKey:VPVPCHMLMOUFEJ-UHFFFAOYSA-N
ID: 32159
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2cc(O)c(CC=C(CCC=C(C)C)C)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -16.217
InChIKey:GCKAYBPEWIVWKX-UHFFFAOYSA-N
ID: 32160
SMILES:C(C(C(CCO)C)=O)c1cc(O)c(C2C=C(C)CCC2(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.87
InChIKey:SHMYPBBGFCEDNS-UHFFFAOYSA-N
ID: 32161
SMILES:C1(C(C)C)C=CC2(C)Oc3c(c(O)cc(CCC)c3)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.217
InChIKey:UMAPEYWRLXCCNN-UHFFFAOYSA-N
ID: 32162
SMILES:C(C)(=CCCC1(C)C=Cc2c(c(O)cc(CCCCC)c2)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 32163
SMILES:C1C2(C)CC(=O)C(C)=CC(=O)C2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -14.755
InChIKey:JNKUPJGYOJQUPN-UHFFFAOYSA-N
ID: 32164
SMILES:C12=CC(OC1=O)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.152
InChIKey:YIDWRSOPEDAKCK-UHFFFAOYSA-N
ID: 32165
SMILES:Oc1c(CC=C(C)CCC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 32166
SMILES:c12c(cc(CCCCC)cc1O)OC(CCC=C(C)CCC=C(C)C)(C)C1CC2C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: -16.506
InChIKey:SKUGPTIVNNBXBN-UHFFFAOYSA-N
ID: 32167
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 32168
SMILES:C1(CC(C)=CCc2cc(O)cc(C)c2OC)CC(O)(C)C(O)CC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.863
InChIKey:CCPNMEZVJWYZHE-UHFFFAOYSA-N
ID: 32169
SMILES:O1c2c(c(O)cc(CC(CC=C(C)C)C3(C)CCC(C(C)(O)C)O3)c2)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.718
InChIKey:YSKZSNKHNZYULC-UHFFFAOYSA-N
ID: 32170
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 32171
SMILES:C(C(C(CO)C)=C)c1c(C(=O)OC2C(O)C(O)C(O)C(CO)O2)c(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.611
CB1 binding score: -14.364
InChIKey:RUYPOYIHQMKTES-UHFFFAOYSA-N
ID: 32172
SMILES:OC(C1=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N