ID: 77785
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 77786
SMILES:C1(O)=C(C)C2(O)C(=O)c3c(O)cc(CCCCC)cc3OC2(C)CCC1C(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -18.455
InChIKey:BRCSXLGGKFUSEI-UHFFFAOYSA-N
ID: 77787
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 77788
SMILES:C1(C)=CC(c2c(=O)c(N=C(O)CCC)cccc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 341.451
CB1 binding score: -15.811
InChIKey:ROPCLLLMWWEAQX-UHFFFAOYSA-N
ID: 77789
SMILES:Oc1cc(CCC)cc2c1C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 77790
SMILES:c1(CCCC)cc(O)c2c(c1)OC(CO)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 266.337
CB1 binding score: -14.942
InChIKey:UBIOEWHNOVGALI-UHFFFAOYSA-N
ID: 77791
SMILES:CC1(C)Oc2c(c(O)cc(CC=C)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.166
InChIKey:FGEQAFJXCIBXCD-UHFFFAOYSA-N
ID: 77792
SMILES:C1(CC(c2c(O)cc(CCCCC)cc2)=O)=C(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.519
InChIKey:FPXHWVPMVKNZFY-UHFFFAOYSA-N
ID: 77793
SMILES:C(C=C(C)C)c1c(C(C(C)C)=O)c(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -15.869
InChIKey:HJXFTPJLSKAJFY-UHFFFAOYSA-N
ID: 77794
SMILES:CC(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C(O)CC(C(=O)OC)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -14.605
InChIKey:NUMJDAPXISEHJX-UHFFFAOYSA-N
ID: 77795
SMILES:C1C(C)CCC2C(C)(C)Oc3c(c(OC)c(C(=O)OC)c(CCc4ccccc4)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -14.636
InChIKey:DXUFKHAHXXCVRX-UHFFFAOYSA-N
ID: 77796
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 77797
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(O)(CCC(C(C)=C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.211
InChIKey:NTDGPIJZNNJRMW-UHFFFAOYSA-N
ID: 77798
SMILES:C(C12c3c(O)cc(C)cc3OC(C)(C)C1CCC(C)=C2)(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.432
InChIKey:NMKLVGMJDKGGAH-UHFFFAOYSA-N
ID: 77799
SMILES:C1=CC=C(C)C2(c3c(cc(CCCC)c(O)c3)OC1(C)C)CC(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -14.48
InChIKey:NTHAVZUFPRYEJY-UHFFFAOYSA-N
ID: 77800
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1)(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.066
InChIKey:ZFPDFRIBAWWFQG-UHFFFAOYSA-N
ID: 77801
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 77802
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC)OC1(O)CC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.35
InChIKey:FSGNKCQKAXOONI-UHFFFAOYSA-N
ID: 77803
SMILES:C(=C(C)C)CCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 77804
SMILES:C(c1c(CCC)cc2c(c1O)C1CC(C)=CCC1C(C)(C)O2)CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.723
InChIKey:CWEHUDYUVZZRCQ-UHFFFAOYSA-N
ID: 77805
SMILES:C(Cc1cc(OC)c(O)c(C2C(C(C)=C)CCC(C)=C2)c1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.863
InChIKey:JJBNVNTYNURQII-UHFFFAOYSA-N