ID: 83749
SMILES:c12c(ccc(C(C)(C)C)c1)C1(C(=O)CC2OC)C(C)(C)OC(C)(C)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.583
InChIKey:PMPIFKCKXNJZMM-UHFFFAOYSA-N
ID: 83750
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C=C(C(=O)O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -18.036
InChIKey:BTTRWQMCLAXICU-UHFFFAOYSA-N
ID: 83751
SMILES:C(CCCC)Cc1cc2c(c(O)c1)CC1C(C)(O2)OC(C(C)(O)C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.944
InChIKey:WNORKZOTNUECTG-UHFFFAOYSA-N
ID: 83752
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(O)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 83753
SMILES:C=C(C1CC(=O)C(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.334
InChIKey:LMTQDQLMOBKYNY-UHFFFAOYSA-N
ID: 83754
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(cccc3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 83755
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 83756
SMILES:O1C2(C)C1C1c3c(O)cc(C)cc3OC(C)(C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.701
InChIKey:FAGFUYFGKBEZOF-UHFFFAOYSA-N
ID: 83757
SMILES:CC1=CC(c2c(OC)ccc(OC)c2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.625
InChIKey:LHCSHORDRBDUGZ-UHFFFAOYSA-N
ID: 83758
SMILES:C1C23CC2(Cc2c(O)cc(CCCCC)cc2O3)C(C)CC1C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.929
InChIKey:IXPUSIKKBCTXKD-UHFFFAOYSA-N
ID: 83759
SMILES:O(C)c1c2c(c(C(=O)CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.24
InChIKey:MJDSSPNZJMMLEU-UHFFFAOYSA-N
ID: 83760
SMILES:Oc1cc(C(C)(O)C)cc(CC=C(CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.414
InChIKey:QGNUFMUGVREMOL-UHFFFAOYSA-N
ID: 83761
SMILES:C(C=C(C)CCC=C(C)C)Oc1cc(O)c2c(c1CCCCCCC)OC(C)(C)C1CCC(C)(O)C=C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.759
CB1 binding score: -15.35
InChIKey:MARMVSQTXVDMGC-UHFFFAOYSA-N
ID: 83762
SMILES:C(OC1C(C)CCC2=C(C=C(C)C)C(C)(C)Oc3c(c(O)cc(C)c3)C12)(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.629
InChIKey:NIQXTFYRIOCNRI-UHFFFAOYSA-N
ID: 83763
SMILES:C1CC2(c3c(cc(CCCCC)cc3O)OC2(C)C)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.852
InChIKey:HMSXJASFHSARFD-UHFFFAOYSA-N
ID: 83764
SMILES:C1C=C(C)CCC(C(O)(C)C)Oc2c(c(O)cc(CCC)c2)C=C1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.093
InChIKey:WYGPHSUZFLSYNM-UHFFFAOYSA-N
ID: 83765
SMILES:c1c2cc(CCCCC)oc2cc2c1OC(C)(C)C1C2C=C(C)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -15.176
InChIKey:WMWXHTYNPWELTP-UHFFFAOYSA-N
ID: 83766
SMILES:C12(C3C(CCC1C(C)=C)C(C)C(OC)C1OC13C(C)C)Oc1c(c(O)cc(CCCCC)c1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -12.804
InChIKey:PIKCHZRHSQOXAT-UHFFFAOYSA-N
ID: 83767
SMILES:c12c(c(=O)cc(C(O)C)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.843
InChIKey:JBEHPUKUYUBVCS-UHFFFAOYSA-N
ID: 83768
SMILES:c12c(c(C)c(CCCCC)cc1)OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.015
InChIKey:MSXGEJFNHZJFQF-UHFFFAOYSA-N
ID: 83769
SMILES:c1(C)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N