ID: 24571
SMILES:c1(OC)c(C2C(C(C)=C)CCC(C)=C2)c(O)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.189
InChIKey:XIKSPZHKWNEGGO-UHFFFAOYSA-N
ID: 24572
SMILES:O1c2cc(CCCCC)ccc2C2C(CCC(CO)=C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -12.307
InChIKey:SVQDDBOJLCXURG-UHFFFAOYSA-N
ID: 24573
SMILES:C(Cc1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.085
InChIKey:DXSKUBRMLHRYFY-UHFFFAOYSA-N
ID: 24574
SMILES:c1(O)c2c(cc(CCCCC)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: 24575
SMILES:C12C(C)(CCC(O)C1(C)O)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.929
InChIKey:CKDNYIAHBQOZMK-UHFFFAOYSA-N
ID: 24576
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=CCCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -13.915
InChIKey:ISGZGQQUZOYNMT-UHFFFAOYSA-N
ID: 24577
SMILES:c1(CCCCC)cc2c(c(O)c1S(=O)(O)=O)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.532
CB1 binding score: -12.976
InChIKey:SHBMLKISXDDJBA-UHFFFAOYSA-N
ID: 24578
SMILES:C(OC(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12)=O)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.721
InChIKey:NMCVWOYLBXOOEY-UHFFFAOYSA-N
ID: 24579
SMILES:c12c(cc(CCCCC)cc1O)OC(CO)C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.003
InChIKey:XCKCZTFQVVJKBP-UHFFFAOYSA-N
ID: 24580
SMILES:C1(C)(O)C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C2CC1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.929
InChIKey:GAMUPUCYWRDZPG-UHFFFAOYSA-N
ID: 24581
SMILES:C(C)CCc1cc2c(c(O)c1)C1C3C2(CC(O)C1C)CC(C)(C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.599
InChIKey:HRYWPRJAXCWJIQ-UHFFFAOYSA-N
ID: 24582
SMILES:CC(C1C2(Oc3c(c(O)cc(CCCCC)c3)C2)C(C)CCC1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.302
InChIKey:NEQJAVXYRHDRAX-UHFFFAOYSA-N
ID: 24583
SMILES:c1c(C(=O)O)c(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.699
InChIKey:AGWZNRSHYXGDKF-UHFFFAOYSA-N
ID: 24584
SMILES:C(CC)Cc1cc(O)c2c(c1O)CC=C(C)C2CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: 5.657
InChIKey:YWWNJWHCJVYLSE-UHFFFAOYSA-N
ID: 24585
SMILES:C1c2c(OC)cc(CCCCC)cc2OC(C(C)=C)C2C=C(C(OC(C)=O)CC=C(C)C1)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: 1.365
InChIKey:QGQYUZWIYJFOBK-UHFFFAOYSA-N
ID: 24586
SMILES:O(c1c(OC)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.162
InChIKey:WANORUPVMQZMGI-UHFFFAOYSA-N
ID: 24587
SMILES:C1=C(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -17.385
InChIKey:XSQXSJJCSPEKHO-UHFFFAOYSA-N
ID: 24588
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 24589
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.789
InChIKey:PNDRGHJPIODUJX-UHFFFAOYSA-N
ID: 24590
SMILES:C1(c2c(O)cc(CCCC)cc2O)C(C(C)=C)CC(C(C)(C)O)CC1C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.396
InChIKey:ZMQSLKYSYATHRJ-UHFFFAOYSA-N
ID: 24591
SMILES:C12(C(C)C)OC(C)(CC1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.339
InChIKey:VANJXDKZXRHENN-UHFFFAOYSA-N