ID: 97294
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 97295
SMILES:c1(-c2cc(OC)ccc2O)oc(=O)c2c3c1OC(C)(C)C1C3C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.52
CB1 binding score: -14.109
InChIKey:MMVVAGCTLFRXHV-UHFFFAOYSA-N
ID: 97296
SMILES:C(CC)Cc1cc2c(c(OC)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.901
InChIKey:PUROKSSERMRLRD-UHFFFAOYSA-N
ID: 97297
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 97298
SMILES:c12c(cc(CCCCC)cc1O)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: 97299
SMILES:c1(O)cc(C)cc2c1C1C3C(CC(C)(C)C3)(O2)CO1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.502
InChIKey:BDKMYTBAVGMIKI-UHFFFAOYSA-N
ID: 97300
SMILES:C1(=C)C2(Oc3c(c(O)c(C(=O)O)c(CCCCC)c3)C2)C(C)(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.411
InChIKey:YGWYGVBCXIPDPO-UHFFFAOYSA-N
ID: 97301
SMILES:CC1=CC(=O)CC(C)(C=CCC(=CCc2c(O)cc(CCCCC)cc2O)C)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -17.123
InChIKey:PKNHFVRJYVCXJX-UHFFFAOYSA-N
ID: 97302
SMILES:C12C(C)(C1)C1C(OC(=O)C)C2(C=O)C(O)c2cc(C(OC)=O)c(CCCCC)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -13.932
InChIKey:VAKBHLPEIXBIDU-UHFFFAOYSA-N
ID: 97303
SMILES:CC1=CCC2C(=CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.794
InChIKey:MQTICKJWFLRNEL-UHFFFAOYSA-N
ID: 97304
SMILES:C1C2=C(c3c(cc(CCCCC)cc3O)O1)C(=C)CO2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -14.167
InChIKey:RORQPOYMPCINSN-UHFFFAOYSA-N
ID: 97305
SMILES:C1=C(C)CC2C(C1)c1c(C)cccc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -13.214
InChIKey:OOHXWZNZODDMHC-UHFFFAOYSA-N
ID: 97306
SMILES:c1(CC=C(CCC=C(C)CCC=C(C)C)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.691
CB1 binding score: -17.202
InChIKey:SRGLIIMRJAWYSI-UHFFFAOYSA-N
ID: 97307
SMILES:CC1(C)Oc2c(c3c(c(CCCCCC)c2)ccc(C)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -15.11
InChIKey:ZJJIDVXIPGZHOA-UHFFFAOYSA-N
ID: 97308
SMILES:O1C2(C)Oc3c(c(O)cc(C)c3)C3C(C(C)C)=CC21C(C)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -11.791
InChIKey:VSUHZPYZEGWYGX-UHFFFAOYSA-N
ID: 97309
SMILES:OC1C(CO)OC(Oc2c(CC=C(C)CC(=O)C=C(C)C)c(O)cc(CCCCC)c2)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -14.615
InChIKey:FUDIMLDGZSGUNZ-UHFFFAOYSA-N
ID: 97310
SMILES:C12c3ccc(C)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 97311
SMILES:C1CC2(C)Oc3cc(CCCC)cc(O)c3C(=O)C2C(C)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.345
InChIKey:DTKPYLMIGGLARQ-UHFFFAOYSA-N
ID: 97312
SMILES:C=C(C)C1CC(C(=C)C)C(c2c(O)cc(CCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.157
InChIKey:LWDZPBRGUXCQCA-UHFFFAOYSA-N
ID: 97313
SMILES:C1=CC(C)(C)Oc2c1c(OC)cc1c2cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -15.682
InChIKey:PZCZYNDFROTGJN-UHFFFAOYSA-N
ID: 97314
SMILES:C(C1C2C3(C)CC(c4c(O)cc(C)cc4O3)C2=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -14.192
InChIKey:GUMINUCWDOOTSJ-UHFFFAOYSA-N