ID: 59494
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C=C2)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.086
InChIKey:JTNXKCXODVSTAX-UHFFFAOYSA-N
ID: 59495
SMILES:C(C)=C(C)COC(c1c2c(c(C(OCC)=O)c(O)c1C(C)C)OC(C)(C)C1C2C=C(COC(C)=O)CC1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.642
CB1 binding score: -16.028
InChIKey:XWPYIMCHKNQDMO-UHFFFAOYSA-N
ID: 59496
SMILES:C(C)(=CCCC1(C)Oc2c(cc(CCCCC)cc2O)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 59497
SMILES:O1C2(C)Oc3c(c(O)c(C(C(C)CC)=O)c(O)c3CC3(C)CCCC3(C)C)c(C)c2Cc2c1cc(C)cc2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -13.198
InChIKey:CMGRBQYGXYGDJN-UHFFFAOYSA-N
ID: 59498
SMILES:O1c2cc(CCCCC)cc(OC)c2C2C1C(=C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.078
InChIKey:ASVCLYPMNBCXQJ-UHFFFAOYSA-N
ID: 59499
SMILES:C(C)CCc1c(O)c(C2C=C(C)C(O)CC2C(C)=C)c(O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.715
InChIKey:VJBCNCQPUKXWMA-UHFFFAOYSA-N
ID: 59500
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 59501
SMILES:c1c2c(c(O)c(C(C=C)(C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.579
InChIKey:OHRMQJYMKKPZND-UHFFFAOYSA-N
ID: 59502
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 59503
SMILES:C(CC)CCCc1cc2c(c3c1OC(C)(C)C=C3)o2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.883
InChIKey:QOBZYIJKJRBXIA-UHFFFAOYSA-N
ID: 59504
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(O)(C)CCC1C(C)C)C#CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.491
InChIKey:WSQRNNBPHNXBBT-UHFFFAOYSA-N
ID: 59505
SMILES:C(CCCCCCCCCCCC)CCc1cc2c(c(O)c1)C1C(C(C)C)CCC(C)(O2)-1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.728
CB1 binding score: -14.414
InChIKey:JQLQJZZLDACOJS-UHFFFAOYSA-N
ID: 59506
SMILES:CCCCCc1cc(OC2CC(C)=CCC2(C)C)cc(C(OC)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.59
InChIKey:ZQMJNIRKWLYGSO-UHFFFAOYSA-N
ID: 59507
SMILES:c1(C(C(O)CCC(C)C)=O)c(O)cc(O)c2c1OC(CCC=C(C)C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.385
InChIKey:SLLRFBAMCMBHLD-UHFFFAOYSA-N
ID: 59508
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N
ID: 59509
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C=CC(C)(O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.25
InChIKey:PGZISGZFEFJPOZ-UHFFFAOYSA-N
ID: 59510
SMILES:C1(C)=CC2c3c(cc(O)c(C)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.84
InChIKey:LEMHOGCTMPDYOF-UHFFFAOYSA-N
ID: 59511
SMILES:c1(O)c(C2C=C(C)CCC2C(=C)C)c(O)c(CC=C(C)C)c(O)c1-c1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -15.761
InChIKey:VDIHAOTYTXRTNE-UHFFFAOYSA-N
ID: 59512
SMILES:O(C(C)=O)c1cc(CCCCC)cc(O)c1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -18.614
InChIKey:RTFRSXSQUQOXEP-UHFFFAOYSA-N
ID: 59513
SMILES:c12c(cc(C(C)(C)CCCCCC)cc1O)OC1(C)CCC(C(O)(C)C)C=C1C(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.683
CB1 binding score: -14.284
InChIKey:NXHQPNAWWYCQFG-UHFFFAOYSA-N
ID: 59514
SMILES:C1(C)(C)Oc2c(c(O)c(C(CC(C)C)=O)c(O)c2O)-c2cc(O)c3c(c21)OC(C)(C)C1CCC(C)=CC31
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.611
CB1 binding score: -15.017
InChIKey:YQGDSYLJLHVFGL-UHFFFAOYSA-N