ID: 22324
SMILES:C12CCC3(C)C=CC(c4c(O)cc(CCCCC)cc4O)C1C2(C)CCC3C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.102
InChIKey:LHIVJOWNXFMWGI-UHFFFAOYSA-N
ID: 22325
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(CO)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.97
InChIKey:XZRBPWSJHXTSSU-UHFFFAOYSA-N
ID: 22326
SMILES:CC(C)=CCCC1=C(C)C(c2cc(CCN(C)C)ccc2OC)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.631
CB1 binding score: -12.053
InChIKey:JCNSMSWGFQBTTO-UHFFFAOYSA-N
ID: 22327
SMILES:C(CCCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.293
InChIKey:WAIFYTFDDBLEDM-UHFFFAOYSA-N
ID: 22328
SMILES:CCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(CO)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.699
InChIKey:PSQVREODWWYKSJ-UHFFFAOYSA-N
ID: 22329
SMILES:C(CC=C(C)C)C(CCCC(=CCc1cc(O)c(C)cc1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.334
InChIKey:RUTPKBVACOSZDU-UHFFFAOYSA-N
ID: 22330
SMILES:C1(C)(C)C(Cc2c(O)cc(CCCCC)cc2O)=C(C)CC=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.662
InChIKey:FORXXUZINAFBSV-UHFFFAOYSA-N
ID: 22331
SMILES:C(CC1(C)CC2C1c1c(cc(CCCCC)cc1O)O2)C=C(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.033
InChIKey:UVZIFGOTUXXLIG-UHFFFAOYSA-N
ID: 22332
SMILES:C1(C)=CCCC(C)=CC(O)CC(C)=CCc2c(OC(C)=O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.423
InChIKey:PHNFZHPUOAOZOP-UHFFFAOYSA-N
ID: 22333
SMILES:C1(=O)C23C(C(C)(C)CCC2)C(c2c(O)cc(CCCCC)cc2O1)C=C(C(=O)OC)C(OC(C)=O)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.616
CB1 binding score: -14.763
InChIKey:ITSWECRHJHJZOZ-UHFFFAOYSA-N
ID: 22334
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C(C(C)=C)CCC(O)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.05
InChIKey:PJRKVDHPIPCCDI-UHFFFAOYSA-N
ID: 22335
SMILES:C(CC1C(C)(C)Oc2cc(CCCCC)c(C(=O)O)cc21)CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.366
InChIKey:WKZDCKPWBDNXOU-UHFFFAOYSA-N
ID: 22336
SMILES:C1=C(COC(C(=O)O)=O)CC2(C)CC3(O)C(C)(C)Oc4c(c(O)cc(CCCCC)c4)C1C32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.551
CB1 binding score: -16.797
InChIKey:SQBORVSQXNNRHC-UHFFFAOYSA-N
ID: 22337
SMILES:C(CCCC)c1cc(OC)c2c(c1)OC(C)(C)C1=C=C(C(C)C)C(=O)C(=O)C1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -13.825
InChIKey:BCSIUEBTKGVENK-UHFFFAOYSA-N
ID: 22338
SMILES:Oc1cc(CCCCC)cc(O)c1C1CC(C)(O)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 22339
SMILES:O=C1C(C)C2(Oc3c(c(OC)cc(CCCCCC)c3)C2)C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.963
InChIKey:JEAXIKWZSXNHPI-UHFFFAOYSA-N
ID: 22340
SMILES:OC1(C)CCC(C(=C)C)C(c2c(O)cc(CCC)cc2O)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.292
InChIKey:ASNLBUKVSBSACY-UHFFFAOYSA-N
ID: 22341
SMILES:C1(C)=CCCC(C)=CCc2c(OC)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: Not available
InChIKey:AGBWAUOUZYTEOU-UHFFFAOYSA-N
ID: 22342
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 22343
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(CC=CC(C)(O)C)O1)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.264
InChIKey:KLXWZBCUEZWSAT-UHFFFAOYSA-N
ID: 22344
SMILES:c1(O)c2c(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