ID: 86521
SMILES:Cc1ccc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 86522
SMILES:C(c1ccc2c(c1)OC(C)(C)C1CC=C(C)C=C12)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -15.437
InChIKey:FZSDHJIBORHHGC-UHFFFAOYSA-N
ID: 86523
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 86524
SMILES:OC(=O)C1=CCCC(O)(C)C2CC(CC2)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -14.605
InChIKey:LEIZOFPQSGMCIY-UHFFFAOYSA-N
ID: 86525
SMILES:C(CCCC)Cc1cc2c(c(O)c1C=O)OC(C)(C)C1CC=C(COC(C(C)C)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.022
InChIKey:FAZBUDCZEAJAMF-UHFFFAOYSA-N
ID: 86526
SMILES:C(Cc1cc(O)c(C2C=C(C)C(O)CC2C(C)C)c(O)c1)N=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.483
CB1 binding score: -15.166
InChIKey:HVFFOGUHEWAYKC-UHFFFAOYSA-N
ID: 86527
SMILES:C1C(C)=CC(c2c(O)cc(O)c3c2OC(C)(C)C(Br)CC3)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.364
CB1 binding score: -15.173
InChIKey:YWQDTVHDNARLAO-UHFFFAOYSA-N
ID: 86528
SMILES:C1(=C)C2C(CC(C)=C1)C(C)(C)Oc1c2cc(O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -15.146
InChIKey:XEUXRUCECNDAPI-UHFFFAOYSA-N
ID: 86529
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCC)c3)C1CC(=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.009
InChIKey:AHNDOCSOZYPQHA-UHFFFAOYSA-N
ID: 86530
SMILES:C1CCC(O)(C)C2(C)C1(C)CC(O)(c1c(O)c(C(=O)O)c(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.518
CB1 binding score: -15.67
InChIKey:HYSCZYCZFFTOKY-UHFFFAOYSA-N
ID: 86531
SMILES:C(C)(CC=CC(CCC=C(C)C)=C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.881
InChIKey:XJGZQRUFAFFUAF-UHFFFAOYSA-N
ID: 86532
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 86533
SMILES:C(C)CCc1cc2c(c(O)c1)C1CC3=C(C)C(=O)C(CC1(C)C(C)C2)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.041
InChIKey:BJSIRNQJUPDOGY-UHFFFAOYSA-N
ID: 86534
SMILES:C1(O)C(C(=C)C)CCC2(C)C1Oc1c(C(OC)=O)c(CCCCC)cc(OC(=O)C)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.309
InChIKey:GYBHWKXTDCKEMG-UHFFFAOYSA-N
ID: 86535
SMILES:C(CCC)c1c(C=O)c(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.348
InChIKey:OCANOLJUUWAHJB-UHFFFAOYSA-N
ID: 86536
SMILES:c1(CCCCC)cc2c(c3c1OC(C)(C)C1=C3C(=O)C(C)(C)O1)CCC(C(C)=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -14.831
InChIKey:GBRANHVCFJCQFH-UHFFFAOYSA-N
ID: 86537
SMILES:CC1=CC(c2cc(CCN(C)C)ccc2OC)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 86538
SMILES:C1(O)CC(C(=C)C)C(c2cc(CCN(C)C)ccc2OC)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -17.933
InChIKey:DOIPOJKBLDXMNY-UHFFFAOYSA-N
ID: 86539
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 86540
SMILES:CC1(C)C(c2c(O)ccc(CCCCC)c2)CC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -14.72
InChIKey:VNNMCJNYCNWVRS-UHFFFAOYSA-N
ID: 86541
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N