ID: 118315
SMILES:O=C1C2(C(C(C)C)=O)C3C(C1(C)CC1C3C(C)(C)O1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -14.957
InChIKey:GIPWKFBBQIMXJK-UHFFFAOYSA-N
ID: 118316
SMILES:C(C)CCc1cc(OC)cc2c1C1C=c3ccccc3=CC1C1=C(C(C)(C)CCC1)C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.671
CB1 binding score: -14.887
InChIKey:PXDLFGORBLWGNL-UHFFFAOYSA-N
ID: 118317
SMILES:CC(C1CCC(C)=CCc2c(O)cc(CCCCC)cc21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.468
InChIKey:ULLCGRYWTXADMG-UHFFFAOYSA-N
ID: 118318
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 118319
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(=O)C1(CC=C(C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 356.506
CB1 binding score: -15.765
InChIKey:AZAXNIQUVHFYBG-UHFFFAOYSA-N
ID: 118320
SMILES:Oc1c2c(c(O)cc1CCCCC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.339
InChIKey:DPWWYSVEFIPIFU-UHFFFAOYSA-N
ID: 118321
SMILES:C1=CC(C)(C)Oc2c1cc(CCCCC)cc2OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.253
InChIKey:GUKVLMTZLHYXOE-UHFFFAOYSA-N
ID: 118322
SMILES:C(=O)(OC1CC2C(C)(C)Oc3c(c(O)cc(C=O)c3)C2C2C=C(C)C(O)CC2C1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -18.242
InChIKey:RQZHEGKNWJOHAJ-UHFFFAOYSA-N
ID: 118323
SMILES:c1(C(C)=O)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.834
InChIKey:MKEBYMYEFFKCQH-UHFFFAOYSA-N
ID: 118324
SMILES:C(Cc1cc(C=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC21)CCc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -14.876
InChIKey:OKJFRXAYLAYLHK-UHFFFAOYSA-N
ID: 118325
SMILES:CC(=C)C1CCC(C)=CC1c1c(O)cc(CC=CC)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -17.258
InChIKey:SOZKWTGQBATADY-UHFFFAOYSA-N
ID: 118326
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 118327
SMILES:CC(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.743
InChIKey:PKLUWGUUSHBNIQ-UHFFFAOYSA-N
ID: 118328
SMILES:c1(C(C)(C)C2=CC3(c4c(OC)cc(CCCCC)cc4OC3CCC(C)C2)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 612.895
CB1 binding score: -12.626
InChIKey:BDFZKYPRILFEJB-UHFFFAOYSA-N
ID: 118329
SMILES:C1(COC(C)=O)OC(Oc2c(CC=C(C)CCC=C(C)C)c(O)c(C(O)=O)c(CCCCC)c2)C(OC(=O)C)C(OC(C)=O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 648.746
CB1 binding score: -14.174
InChIKey:XXBJXZLJAUCOBE-UHFFFAOYSA-N
ID: 118330
SMILES:C12(C)CCCC(CO)C1c1c(cc(CCCCC)cc1OC)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -13.238
InChIKey:DFIBDWJBHWEIMO-UHFFFAOYSA-N
ID: 118331
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)c(OC)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.382
CB1 binding score: -17.219
InChIKey:WTOVBVAFKTWLEM-UHFFFAOYSA-N
ID: 118332
SMILES:C1CC(OC(C)=O)(C(C)C)C2C(OC)c3c(O)cc(CCCCC)cc3OC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.929
InChIKey:VJQFVGMGPWZUCJ-UHFFFAOYSA-N
ID: 118333
SMILES:c1(C2C(C(C)=C)CCC(C)=C2)c(O)cc(O)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.407
InChIKey:QMFTYLCWBOBNGL-UHFFFAOYSA-N
ID: 118334
SMILES:C1(C)(C)C2CC=C(C(O)=O)CC2c2c(cc(CCCCC)c(OC(=O)C)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -14.826
InChIKey:XIJDKXHIGGWEHR-UHFFFAOYSA-N
ID: 118335
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N