ID: 49204
SMILES:C(CCC=C(CO)C)(C)=CCc1c(O)cc(CC(O)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.578
InChIKey:XVBOOLFDLJHVCF-UHFFFAOYSA-N
ID: 49205
SMILES:[n+]1(C)c2c(c(=O)n(O)c1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 291.371
CB1 binding score: -15.434
InChIKey:GPTVYFYRTYZROL-UHFFFAOYSA-N
ID: 49206
SMILES:C1C2c3c(O)cc(CCCCC)cc3OC1(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.385
InChIKey:OEDPJGVWHANUAE-UHFFFAOYSA-N
ID: 49207
SMILES:C12(C)OC1c1c(cc(CCCCC)cc1O)OC(C)(CCC=C(COC(=O)C)CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -15.929
InChIKey:CIYGYDFXPWAKIQ-UHFFFAOYSA-N
ID: 49208
SMILES:CC(=CCCC(=C)C1CC=C(C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: -16.851
InChIKey:JXTRHIJXJUXZDE-UHFFFAOYSA-N
ID: 49209
SMILES:C(C)CCCc1cc(O)c(C=O)c2c1OC(C)(C)C1CCC(O)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.62
InChIKey:ZGYDKIRHOSCXPM-UHFFFAOYSA-N
ID: 49210
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 49211
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 49212
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.334
InChIKey:UOQAQJLARPRUBJ-UHFFFAOYSA-N
ID: 49213
SMILES:O1C23CC(C)CC(c4c(O)cc(CCCC)cc4O2)C3C1(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.929
InChIKey:MMILQZQXRUYXOA-UHFFFAOYSA-N
ID: 49214
SMILES:c1(O)c2c(cc(CCCCCC)c1)OC(C)(C)C1C(C=C(C)CC1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.658
InChIKey:OAQWFFGSLTXFDC-UHFFFAOYSA-N
ID: 49215
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c2c3c(c1)OC1(C)C(C3)OC(C)(C)C=CC1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -16.582
InChIKey:OCLVWBHDBNXVKQ-UHFFFAOYSA-N
ID: 49216
SMILES:C(CCCC)c1cc2c(c(O)c1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.671
InChIKey:GYDAWSDIXDFZPV-UHFFFAOYSA-N
ID: 49217
SMILES:CC1(C)Oc2c(c(OC(=O)C)cc(CCCCC)c2)-c2cc(ccc2O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.456
CB1 binding score: -14.12
InChIKey:CVEMFBPJXUQSPK-UHFFFAOYSA-N
ID: 49218
SMILES:Oc1c(C(C(C)C)=O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.559
InChIKey:MBMTVRGIUNPHES-UHFFFAOYSA-N
ID: 49219
SMILES:C1C2C(C)(C)Oc3c(c(O)c(C(=O)CCC)c(O)c3C=O)C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -17.904
InChIKey:SVDXUVMTYQUUIA-UHFFFAOYSA-N
ID: 49220
SMILES:C12c3c(cc(CCCCC)cc3OC1(C)C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.561
InChIKey:MYGDLCPNFACPHH-UHFFFAOYSA-N
ID: 49221
SMILES:C(CC)Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 49222
SMILES:C(C=C(C)CCC=C(CCC=C(C)C)C)c1c(O)cc(CCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 49223
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 49224
SMILES:c1(C)cc2c(cc1)C(C)(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -18.629
InChIKey:YEDIZIGYIMTZKP-UHFFFAOYSA-N