ID: 94774
SMILES:CC(CCC(=O)c1c(O)c(C(=O)C(CC)C)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.839
InChIKey:OQGYZXGSPNCSDU-UHFFFAOYSA-N
ID: 94775
SMILES:C1(C(C)(OC)C)Oc2cc(CCCCC)cc3c2C(C(C)CC3C=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.733
InChIKey:YNSMTBXMRYFZIS-UHFFFAOYSA-N
ID: 94776
SMILES:Oc1c2c(cc(CC3C(=O)C(C)(C)C(O)C3)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.031
InChIKey:MZODMNSJSKWRRN-UHFFFAOYSA-N
ID: 94777
SMILES:c1(CCCCC)cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 94778
SMILES:C(C=Cc1ccc2c(c1)OC(C)(C)C1CC=C(C)CC21)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -16.299
InChIKey:XVBGQOUKIHHVKS-UHFFFAOYSA-N
ID: 94779
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.112
InChIKey:FQYMLYZDNNQIIN-UHFFFAOYSA-N
ID: 94780
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2(O)C1=C(C)C(O)CC2C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.987
InChIKey:UKCJXOHUNFKXEG-UHFFFAOYSA-N
ID: 94781
SMILES:C(Cc1c(CCCC)cc2c(c1O)OC(C)(C)C1C2CC(CO)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -14.395
InChIKey:NFDOLHKBOOKMER-UHFFFAOYSA-N
ID: 94782
SMILES:c1c2c(cc(CC=C(C)CCC=C(C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.573
CB1 binding score: -15.501
InChIKey:NFVJYPIEBWOJFA-UHFFFAOYSA-N
ID: 94783
SMILES:C(=O)(C)OCC(OC(C(CC)=CC)=O)C(C)c1c(Oc2cc(C)ccc2)c(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.712
CB1 binding score: -14.849
InChIKey:YLXJLGOFNHZGBD-UHFFFAOYSA-N
ID: 94784
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(CO)CCC1C(C)(CC2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.046
InChIKey:VATQUTCGLMWYEO-UHFFFAOYSA-N
ID: 94785
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 94786
SMILES:OC1C(=C)CCC2C(C)(C)Oc3cc(C)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.418
InChIKey:HYPQIHIZKCJFBZ-UHFFFAOYSA-N
ID: 94787
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCC)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 94788
SMILES:C(Cc1c(C)c(C)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.535
CB1 binding score: -15.372
InChIKey:QXSIZTOQINMRAQ-UHFFFAOYSA-N
ID: 94789
SMILES:CC1(C)C2CCC(COC)C=C2c2c(cc(CCCCCO)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.864
InChIKey:VVLLOODMXYIIMO-UHFFFAOYSA-N
ID: 94790
SMILES:C(C)(O)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.292
InChIKey:HWUNZNLHTIODBY-UHFFFAOYSA-N
ID: 94791
SMILES:C(CCCCCC)c1cc(O)c2c(c1O)C1C(C(C)(C)O2)CCC(C)(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: Not available
InChIKey:YUGRMCNMLSLQTF-UHFFFAOYSA-N
ID: 94792
SMILES:c12cc(CCCCC)cc(O)c1C1C(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: 94793
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 94794
SMILES:C1CCC2(C)Oc3c(c(O)cc(CCCCC)c31)C(C=C(C)C)C(O)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.694
InChIKey:KKUZAHICPWNXRO-UHFFFAOYSA-N